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5-Tert-butyl-2,4-dihydroxybenzophenone, bis(trimethylacetate)

View entire compound with spectra: 1 NMR, and 1 FTIR

5-Tert-butyl-2,4-dihydroxybenzophenone, bis(trimethylacetate)
SpectraBase Compound ID 99oYwleKw5K
InChI InChI=1S/C27H34O5/c1-25(2,3)19-15-18(22(28)17-13-11-10-12-14-17)20(31-23(29)26(4,5)6)16-21(19)32-24(30)27(7,8)9/h10-16H,1-9H3
InChIKey ALEIOHIGHGAMEF-UHFFFAOYSA-N
Mol Weight 438.6 g/mol
Molecular Formula C27H34O5
Exact Mass 438.240624 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JbpuO5cDLSA
Name 5-Tert-butyl-2,4-dihydroxybenzophenone, bis(trimethylacetate)
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 438.240624190 u
Formula C27H34O5
InChI InChI=1S/C27H34O5/c1-25(2,3)19-15-18(22(28)17-13-11-10-12-14-17)20(31-23(29)26(4,5)6)16-21(19)32-24(30)27(7,8)9/h10-16H,1-9H3
InChIKey ALEIOHIGHGAMEF-UHFFFAOYSA-N
Molecular Weight 438.564 g/mol
SMILES C1(OC(C(C)(C)C)=O)=C(C=C(C(=C1)OC(C(C)(C)C)=O)C(=O)C1=CC=CC=C1)C(C)(C)C